4-(2,4-dimethoxyphenyl)-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,4-dimethoxyphenyl)-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,4-dimethoxyphenyl)-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide CAS Name: 4-(2,4-dimethoxyphenyl)-N-(2,4,5-trimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,4-dimethoxyphenyl)-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,4-dimethoxyphenyl)-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)OC)OC)C

InChI

InChI=1S/C22H29N3O2S/c1-15-12-17(3)19(13-16(15)2)23-22(28)25-10-8-24(9-11-25)20-7-6-18(26-4)14-21(20)27-5/h6-7,12-14H,8-11H2,1-5H3,(H,23,28)